Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL15313117

C=CC(=O)OC(C)(C)C(C)O.N

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.41
ALDH1A1 P00352 4/20 0.31
TP53 P04637 3/20 0.31
HIF1A Q16665 3/20 0.31
CYP3A4 P08684 2/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.30
THRB P10828 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6928978 0.98 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2740738 0.85 TSHR (0.45) TSHRALDH1A1TP53HIF1ACYP3A4
Ethane SCHEMBL1585650 0.83 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27281544 0.81 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23494179 0.79 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3990177 0.79 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27801991 0.79 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
Hydrochloric Acid SCHEMBL21955704 0.79 TSHR (0.37) TSHR
SCHEMBL14610245 0.78 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL12428762 0.76 TSHR (0.38) TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016066633-A1 NEW FILTRATION PROCESSES BASF SE (DE) 2016-05-06 WO disclosed
US-9321869-B2 Cationic polymers BASF SE (DE) 2016-04-26 US disclosed
US-20150087796-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2015-03-26 US disclosed
EP-2836525-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2015-02-18 EP disclosed
WO-2013153004-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2013-10-17 WO disclosed
US-20130274369-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2013-10-17 US disclosed